O5-ethyl O2-(phenylmethyl) 3-ethyl-4-methyl-1H-pyrrole-2,5-dicarboxylate

Systemtic Name: O5-ethyl O2-(phenylmethyl) 3-ethyl-4-methyl-1H-pyrrole-2,5-dicarboxylate Openeye Name: O2-benzyl O5-ethyl 3-ethyl-4-methyl-1H-pyrrole-2,5-dicarboxylate CAS Name: 3-ethyl-4-methyl-1H-pyrrole-2,5-dicarboxylic acid O5-ethyl ester O2-(phenylmethyl) ester IUPAC Name: 2-O-benzyl 5-O-ethyl 3-ethyl-4-methyl-1H-pyrrole-2,5-dicarboxylate Traditional Name: 3-ethyl-4-methyl-1H-pyrrole-2,5-dicarboxylic acid O2-benzyl ester O5-ethyl ester Formula: C18H21NO4 MolecularWeight: 315.36364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C)C(=O)OCC)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC1=C(NC(=C1C)C(=O)OCC)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H21NO4/c1-4-14-12(3)15(17(20)22-5-2)19-16(14)18(21)23-11-13-9-7-6-8-10-13/h6-10,19H,4-5,11H2,1-3H3